4-(methylamino)-3-nitro-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 4-(methylamino)-3-nitro-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 4-(methylamino)-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 4-(methylamino)-3-nitro-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 4-(methylamino)-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: N-[3-(2-ketopyrrolidino)phenyl]-4-(methylamino)-3-nitro-benzamide Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)N3CCCC3=O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)N3CCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4/c1-19-15-8-7-12(10-16(15)22(25)26)18(24)20-13-4-2-5-14(11-13)21-9-3-6-17(21)23/h2,4-5,7-8,10-11,19H,3,6,9H2,1H3,(H,20,24)